A0A5K4FFD2_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FFD2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 55 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41Very low61.1Low221 Ų22196.5 Ų96.5100%1.08950%0.497SS*.  01200-177.1178.5-74.800106.6I3M1-I3 HydrophobicContact CG-CD1 4.33Å; M1-I3 HydrophobicContact CG-CG1 3.98Å; M1-I3 HydrophobicContact SD-CD1 4.02Å; M1-I3 HydrophobicContact SD-CG1 4.29Å
2S44.3Very low61.5Low103 Ų10398.9 Ų98.972%0.7250%0.495SS*.  trans-98.4122.2175.5-176.30000107.6
3I54.2Low61.7Low87 Ų8791.8 Ų91.845%0.44646%0.459SS..  trans-117.5121.8177.9-50.7176000106.3M1 Y5M1-I3 HydrophobicContact CG-CD1 4.33Å; M1-I3 HydrophobicContact CG-CG1 3.98Å; M1-I3 HydrophobicContact SD-CD1 4.02Å; M1-I3 HydrophobicContact SD-CG1 4.29Å; I3-Y5 HydrophobicContact CB-CD2 4.44Å; I3-Y5 HydrophobicContact CB-CE1 4.43Å; I3-Y5 HydrophobicContact CB-CE2 3.67Å; I3-Y5 HydrophobicContact CG2-CD1 4.18Å; I3-Y5 HydrophobicContact CG2-CD2 4.3Å; I3-Y5 HydrophobicContact CG2-CE1 3.51Å; I3-Y5 HydrophobicContact CG2-CE2 3.66Å; I3-Y5 WeakPolarHBondContact CG2-OH 3.41Å; I3-Y5 WeakPolarHBondContact O-CD2 2.98Å; I3-Y5 WeakPolarHBondContact O-CE2 3.21Å
4H60.1Low62Low131 Ų13190 Ų9061%0.60645%0.451SS*.  trans-95.9129.6-174.8-16161000110.2
5Y65.4Low62Low54 Ų5487.3 Ų87.321%0.21244%0.442CS..  trans-127.285.1-172.6-58.2-73.4000110.5I3 H7 G8 M9 I50 P52I3-Y5 HydrophobicContact CB-CD2 4.44Å; I3-Y5 HydrophobicContact CB-CE1 4.43Å; I3-Y5 HydrophobicContact CB-CE2 3.67Å; I3-Y5 HydrophobicContact CG2-CD1 4.18Å; I3-Y5 HydrophobicContact CG2-CD2 4.3Å; I3-Y5 HydrophobicContact CG2-CE1 3.51Å; I3-Y5 HydrophobicContact CG2-CE2 3.66Å; I3-Y5 WeakPolarHBondContact CG2-OH 3.41Å; I3-Y5 WeakPolarHBondContact O-CD2 2.98Å; I3-Y5 WeakPolarHBondContact O-CE2 3.21Å; Y5-H7 PolarHBondContact O-N 3.32Å; Y5-H7 VanDerWaalsContact O-N 3.07Å; Y5-G8 PolarHBondContact O-N 3.23Å; Y5-M9 VanDerWaalsContact CB-SD 3.59Å; Y5-M9 HydrophobicContact CD2-CE 4.15Å; Y5-M9 HydrophobicContact CD2-CG 4.37Å; Y5-M9 HydrophobicContact CD2-SD 2.95Å; Y5-M9 WeakPolarHBondContact CD2-SD 3.39Å; Y5-M9 HydrophobicContact CE2-CE 4.23Å; Y5-M9 HydrophobicContact CE2-SD 3.52Å; Y5-M9 VanDerWaalsContact CE2-SD 3.52Å; Y5-M9 HydrophobicContact CG-CG 4.4Å; Y5-M9 HydrophobicContact CG-SD 3.45Å; Y5-I50 HydrophobicContact CE2-CG2 4.18Å; Y5-P52 HydrophobicContact CD1-CB 3.51Å; Y5-P52 HydrophobicContact CD1-CG 4.03Å; Y5-P52 HydrophobicContact CE1-CB 3.83Å; Y5-P52 HydrophobicContact CE1-CG 3.82Å; Y5-P52 HydrophobicContact CG-CB 4.47Å
6P66.1Low61.9Low96 Ų9690 Ų9062%0.62345%0.453SS*.THydrogen-bonded Turntrans-65.1-18.1-166.623.1-33000114.7
7H71.4Confident61.6Low82 Ų8295.6 Ų95.638%0.3848%0.477SS..THydrogen-bonded Turntrans-104.910.1-180-53-54.6000112.8Y5 K53 N55Y5-H7 PolarHBondContact O-N 3.32Å; Y5-H7 VanDerWaalsContact O-N 3.07Å; H7-K53 HydrophobicContact CB-CB 3.97Å; H7-K53 WeakPolarHBondContact CB-O 3.3Å; H7-K53 WeakPolarHBondContact O-CB 3.4Å; H7-K53 WeakPolarHBondContact O-CD 3.5Å; H7-N55 PolarHBondContact CE1-ND2 3.35Å; H7-N55 PolarHBondContact CE1-OD1 3.07Å; H7-N55 PolarHBondContact ND1-OD1 3.47Å; H7-N55 PolarHBondContact NE2-ND2 3.39Å
8G68.6Low61.7Low29 Ų2991.8 Ų91.830%0.29946%0.459SS..  trans75.3-170.8-171.300000112.3Y5 K53Y5-G8 PolarHBondContact O-N 3.23Å; G8-K53 PolarHBondContact O-N 3.07Å
9M71.1Confident61.9Low42 Ų4297.8 Ų97.821%0.20748%0.477CS..EExtended strand (participates in β ladder)trans-146.9159.1-162.8-3.8-154.9-73.200110.1Y5 M30 I50Y5-M9 VanDerWaalsContact CB-SD 3.59Å; Y5-M9 HydrophobicContact CD2-CE 4.15Å; Y5-M9 HydrophobicContact CD2-CG 4.37Å; Y5-M9 HydrophobicContact CD2-SD 2.95Å; Y5-M9 WeakPolarHBondContact CD2-SD 3.39Å; Y5-M9 HydrophobicContact CE2-CE 4.23Å; Y5-M9 HydrophobicContact CE2-SD 3.52Å; Y5-M9 VanDerWaalsContact CE2-SD 3.52Å; Y5-M9 HydrophobicContact CG-CG 4.4Å; Y5-M9 HydrophobicContact CG-SD 3.45Å; M9-M30 HydrophobicContact CE-CE 2.93Å; M9-M30 HydrophobicContact CE-CG 4.18Å; M9-M30 HydrophobicContact CE-SD 3.26Å; M9-M30 WeakPolarHBondContact CE-SD 3.35Å; M9-I50 HydrophobicContact CB-CG2 4.25Å; M9-I50 HydrophobicContact CE-CG2 3.8Å; M9-I50 HydrophobicContact SD-CG2 4.25Å
10R67.2Low62.1Low185 Ų18597.7 Ų97.770%0.69847%0.472SS*.EExtended strand (participates in β ladder)trans-121.6137164.5-87.9-177.6167172.7-3.6108.7I51R10-I51 PolarHBondContact N-O 3.18Å; R10-I51 PolarHBondContact O-N 3Å
11T63Low62.4Low31 Ų3198 Ų9819%0.1947%0.473CS..EExtended strand (participates in β ladder)trans-106.8131.717546.20000109.5M30 F32 T49 I50T11-M30 HydrophobicContact CG2-CE 4.37Å; T11-M30 HydrophobicContact CG2-SD 4.05Å; T11-F32 HydrophobicContact CG2-CE1 3.89Å; T11-F32 HydrophobicContact CG2-CZ 3.79Å; T11-T49 WeakPolarHBondContact CA-O 3.48Å; T11-I50 HydrophobicContact CG2-CG1 4.28Å
12R65Low63.6Low126 Ų12690.1 Ų90.148%0.47544%0.437SS..EExtended strand (participates in β ladder)trans-114.9135169.6-173.6-178.3-178.7-164.2-0.4108.6E16 T49R12-E16 IonicContact CZ-OE1 3.32Å; R12-E16 IonicContact NE-OE1 3.05Å; R12-E16 PolarHBondContact NE-OE1 2.57Å; R12-E16 IonicContact NH2-OE1 2.74Å; R12-E16 PolarHBondContact NH2-OE1 3.07Å; R12-T49 PolarHBondContact N-O 3.05Å; R12-T49 PolarHBondContact O-N 3.04Å
13F64.8Low64.5Low6 Ų691.4 Ų91.43%0.02643%0.427CS..EExtended strand (participates in β ladder)trans-116.2137176.1-61.8-88.2000109.3P15 E16 Y20 F32 I34 E47 I48F13-P15 CarbonylContact O-C 3.54Å; F13-E16 WeakPolarHBondContact O-CA 3.42Å; F13-E16 WeakPolarHBondContact O-CG 3.33Å; F13-E16 PolarHBondContact O-N 3.4Å; F13-Y20 HydrophobicContact CB-CD1 4.5Å; F13-Y20 AromaticContact CD2-CD1 3.48Å; F13-Y20 HydrophobicContact CD2-CD1 3.48Å; F13-Y20 VanDerWaalsContact CD2-CD1 3.48Å; F13-Y20 AromaticContact CD2-CD2 3.96Å; F13-Y20 HydrophobicContact CD2-CD2 3.96Å; F13-Y20 AromaticContact CD2-CE1 3.36Å; F13-Y20 HydrophobicContact CD2-CE1 3.36Å; F13-Y20 AromaticContact CD2-CE2 3.84Å; F13-Y20 HydrophobicContact CD2-CE2 3.84Å; F13-Y20 AromaticContact CD2-CG 3.79Å; F13-Y20 HydrophobicContact CD2-CG 3.79Å; F13-Y20 AromaticContact CD2-CZ 3.55Å; F13-Y20 AromaticContact CE2-CD1 3.92Å; F13-Y20 HydrophobicContact CE2-CD1 3.92Å; F13-Y20 AromaticContact CE2-CD2 3.49Å; F13-Y20 HydrophobicContact CE2-CD2 3.49Å; F13-Y20 VanDerWaalsContact CE2-CD2 3.49Å; F13-Y20 AromaticContact CE2-CE1 3.88Å; F13-Y20 HydrophobicContact CE2-CE1 3.88Å; F13-Y20 AromaticContact CE2-CE2 3.43Å; F13-Y20 HydrophobicContact CE2-CE2 3.43Å; F13-Y20 VanDerWaalsContact CE2-CE2 3.43Å; F13-Y20 AromaticContact CE2-CG 3.74Å; F13-Y20 HydrophobicContact CE2-CG 3.74Å; F13-Y20 AromaticContact CE2-CZ 3.63Å; F13-Y20 HydrophobicContact CG-CD1 4.07Å; F13-Y20 HydrophobicContact CG-CE1 4.26Å; F13-Y20 HydrophobicContact CG-CG 4.44Å; F13-Y20 HydrophobicContact CZ-CD2 4.16Å; F13-Y20 HydrophobicContact CZ-CE2 4.44Å; F13-Y20 HydrophobicContact CZ-CG 4.37Å; F13-F32 AromaticContact CE1-CD1 3.96Å; F13-F32 HydrophobicContact CE1-CD1 3.96Å; F13-F32 HydrophobicContact CE1-CE1 4.29Å; F13-F32 HydrophobicContact CE1-CG 4.18Å; F13-F32 HydrophobicContact CE2-CD1 4.4Å; F13-F32 HydrophobicContact CE2-CE1 4.35Å; F13-F32 AromaticContact CZ-CD1 3.38Å; F13-F32 HydrophobicContact CZ-CD1 3.38Å; F13-F32 AromaticContact CZ-CE1 3.46Å; F13-F32 HydrophobicContact CZ-CE1 3.46Å; F13-F32 VanDerWaalsContact CZ-CE1 3.46Å; F13-F32 HydrophobicContact CZ-CG 4.06Å; F13-F32 HydrophobicContact CZ-CZ 4.17Å; F13-I34 HydrophobicContact CD1-CD1 3.68Å; F13-I34 HydrophobicContact CE1-CD1 3.64Å; F13-E47 WeakPolarHBondContact CA-O 3.41Å; F13-I48 HydrophobicContact CD1-CB 4.45Å; F13-I48 HydrophobicContact CD1-CG1 3.86Å; F13-I48 HydrophobicContact CD1-CG2 4.33Å; F13-I48 HydrophobicContact CE1-CB 4.18Å; F13-I48 HydrophobicContact CE1-CD1 3.94Å; F13-I48 HydrophobicContact CE1-CG1 3.68Å; F13-I48 HydrophobicContact CE1-CG2 3.68Å; F13-I48 HydrophobicContact CZ-CG2 4.13Å
14I65.7Low64.9Low67 Ų6794 Ų9434%0.34444%0.437SS..EExtended strand (participates in β ladder)trans-121129.1169.9-59.6-176.8000107.9E47I14-E47 HydrophobicContact CB-CB 4.47Å; I14-E47 PolarHBondContact N-O 3.28Å; I14-E47 VanDerWaalsContact N-O 3.15Å; I14-E47 PolarHBondContact O-N 3.04Å
15P62Low65Low49 Ų4992.1 Ų92.132%0.31843%0.431SS..SBendcis-68.6141.4-0.825.8-32.4000113.5F13 Q17 L18F13-P15 CarbonylContact O-C 3.54Å; P15-Q17 PolarHBondContact O-N 3.39Å; P15-L18 HydrophobicContact CG-CD1 3.78Å; P15-L18 HydrophobicContact CG-CG 4.07Å; P15-L18 PolarHBondContact O-N 3.39Å
16E61.1Low65.1Low131 Ų13197.3 Ų97.361%0.61246%0.463SS*.THydrogen-bonded Turntrans-63.5-9.8-175.7-72172.1172.200113.8R12 F13R12-E16 IonicContact CZ-OE1 3.32Å; R12-E16 IonicContact NE-OE1 3.05Å; R12-E16 PolarHBondContact NE-OE1 2.57Å; R12-E16 IonicContact NH2-OE1 2.74Å; R12-E16 PolarHBondContact NH2-OE1 3.07Å; F13-E16 WeakPolarHBondContact O-CA 3.42Å; F13-E16 WeakPolarHBondContact O-CG 3.33Å; F13-E16 PolarHBondContact O-N 3.4Å
17Q56.8Low65Low185 Ų18596.1 Ų96.186%0.86445%0.454SS*.THydrogen-bonded Turntrans-89.2-3.2-177.5-61.2-180-8.100113.8P15 Y19P15-Q17 PolarHBondContact O-N 3.39Å; Q17-Y19 PolarHBondContact O-N 2.98Å
18L63.1Low64.7Low28 Ų2897.3 Ų97.315%0.14746%0.463CS..  trans-72.5124.2176.3-72.7162.2000109.6P15 Y20 I34 P35 I46P15-L18 HydrophobicContact CG-CD1 3.78Å; P15-L18 HydrophobicContact CG-CG 4.07Å; P15-L18 PolarHBondContact O-N 3.39Å; L18-Y20 WeakPolarHBondContact O-CD1 3.38Å; L18-Y20 PolarHBondContact O-N 3.44Å; L18-I34 HydrophobicContact CB-CG2 3.99Å; L18-I34 HydrophobicContact CD1-CG2 3.77Å; L18-I34 HydrophobicContact CD2-CG2 4.11Å; L18-I34 HydrophobicContact CG-CG2 4.17Å; L18-P35 WeakPolarHBondContact CD2-O 3.5Å; L18-I46 HydrophobicContact CD1-CG1 4.44Å
19Y64.9Low64.5Low205 Ų205100.4 Ų100.480%0.80447%0.472SS*.  trans-61.7132164.4-110.7-92.2000108.3Q17 P35Q17-Y19 PolarHBondContact O-N 2.98Å; Y19-P35 WeakPolarHBondContact O-CD 3.4Å
20Y67.2Low64.5Low96 Ų96100.5 Ų100.538%0.37647%0.472SS..  trans-140.2147.6174.263.6-90.9000111.2F13 L18 V22 Y33F13-Y20 HydrophobicContact CB-CD1 4.5Å; F13-Y20 AromaticContact CD2-CD1 3.48Å; F13-Y20 HydrophobicContact CD2-CD1 3.48Å; F13-Y20 VanDerWaalsContact CD2-CD1 3.48Å; F13-Y20 AromaticContact CD2-CD2 3.96Å; F13-Y20 HydrophobicContact CD2-CD2 3.96Å; F13-Y20 AromaticContact CD2-CE1 3.36Å; F13-Y20 HydrophobicContact CD2-CE1 3.36Å; F13-Y20 AromaticContact CD2-CE2 3.84Å; F13-Y20 HydrophobicContact CD2-CE2 3.84Å; F13-Y20 AromaticContact CD2-CG 3.79Å; F13-Y20 HydrophobicContact CD2-CG 3.79Å; F13-Y20 AromaticContact CD2-CZ 3.55Å; F13-Y20 AromaticContact CE2-CD1 3.92Å; F13-Y20 HydrophobicContact CE2-CD1 3.92Å; F13-Y20 AromaticContact CE2-CD2 3.49Å; F13-Y20 HydrophobicContact CE2-CD2 3.49Å; F13-Y20 VanDerWaalsContact CE2-CD2 3.49Å; F13-Y20 AromaticContact CE2-CE1 3.88Å; F13-Y20 HydrophobicContact CE2-CE1 3.88Å; F13-Y20 AromaticContact CE2-CE2 3.43Å; F13-Y20 HydrophobicContact CE2-CE2 3.43Å; F13-Y20 VanDerWaalsContact CE2-CE2 3.43Å; F13-Y20 AromaticContact CE2-CG 3.74Å; F13-Y20 HydrophobicContact CE2-CG 3.74Å; F13-Y20 AromaticContact CE2-CZ 3.63Å; F13-Y20 HydrophobicContact CG-CD1 4.07Å; F13-Y20 HydrophobicContact CG-CE1 4.26Å; F13-Y20 HydrophobicContact CG-CG 4.44Å; F13-Y20 HydrophobicContact CZ-CD2 4.16Å; F13-Y20 HydrophobicContact CZ-CE2 4.44Å; F13-Y20 HydrophobicContact CZ-CG 4.37Å; L18-Y20 WeakPolarHBondContact O-CD1 3.38Å; L18-Y20 PolarHBondContact O-N 3.44Å; Y20-V22 HydrophobicContact CD2-CG2 3.65Å; Y20-V22 HydrophobicContact CE2-CG2 3.71Å; Y20-Y33 VanDerWaalsContact CA-O 3.3Å; Y20-Y33 WeakPolarHBondContact CA-O 3.26Å
21E66.5Low64.6Low104 Ų10497.5 Ų97.549%0.48647%0.465SS..EExtended strand (participates in β ladder)trans-112.3131.3168.2-71.4-177.316600109.1Y23 Y33E21-Y23 HydrophobicContact CB-CD2 4.32Å; E21-Y23 HydrophobicContact CB-CE2 3.65Å; E21-Y23 WeakPolarHBondContact OE2-CE2 2.95Å; E21-Y23 PolarHBondContact OE2-OH 3.31Å; E21-Y33 PolarHBondContact N-O 3.25Å; E21-Y33 PolarHBondContact O-N 3.22Å
22V66.2Low64.9Low55 Ų5598.8 Ų98.833%0.33347%0.468SS..EExtended strand (participates in β ladder)trans-105.3119.1173.9-172.50000108Y20 E24 M30 F32Y20-V22 HydrophobicContact CD2-CG2 3.65Å; Y20-V22 HydrophobicContact CE2-CG2 3.71Å; V22-E24 HydrophobicContact CG1-CG 4.45Å; V22-M30 HydrophobicContact CG1-CG 4.12Å; V22-M30 HydrophobicContact CG1-SD 4.05Å; V22-F32 HydrophobicContact CB-CE1 4.41Å; V22-F32 HydrophobicContact CG1-CD1 4.44Å; V22-F32 HydrophobicContact CG1-CE1 3.93Å; V22-F32 HydrophobicContact CG2-CD1 3.96Å; V22-F32 HydrophobicContact CG2-CE1 3.8Å
23Y64.5Low65.2Low131 Ų131100.3 Ų100.351%0.51448%0.475SS..EExtended strand (participates in β ladder)trans-101.9106.8172.4-66.8-93.6000108.8E21 F31E21-Y23 HydrophobicContact CB-CD2 4.32Å; E21-Y23 HydrophobicContact CB-CE2 3.65Å; E21-Y23 WeakPolarHBondContact OE2-CE2 2.95Å; E21-Y23 PolarHBondContact OE2-OH 3.31Å; Y23-F31 PolarHBondContact N-O 3.34Å; Y23-F31 VanDerWaalsContact N-O 3.16Å; Y23-F31 PolarHBondContact O-N 3.16Å
24E62.4Low65.4Low142 Ų142101.4 Ų101.466%0.66448%0.481SS*.EExtended strand (participates in β ladder)trans-91.1118.4168.3-80-173.516000109.3V22 M30V22-E24 HydrophobicContact CG1-CG 4.45Å; E24-M30 HydrophobicContact CG-CG 4.18Å
25N61.8Low65.4Low90 Ų90101.2 Ų101.248%0.48148%0.484SS..EExtended strand (participates in β ladder)trans-100.8156164.8-178.6-1.9000108.3T27 N28N25-T27 PolarHBondContact ND2-OG1 3.05Å; N25-T27 PolarHBondContact O-N 3.38Å; N25-N28 PolarHBondContact O-N 3.43Å
26N67.1Low65.6Low164 Ų164101 Ų10188%0.87748%0.483SS*.THydrogen-bonded Turntrans-550.3172.1-56.9-6.4000114.1
27T63.9Low65.5Low71 Ų71100.2 Ų100.244%0.43649%0.487SS..THydrogen-bonded Turntrans-95.68.6-176.854.10000114.5N25 L29N25-T27 PolarHBondContact ND2-OG1 3.05Å; N25-T27 PolarHBondContact O-N 3.38Å; T27-L29 PolarHBondContact O-N 3.15Å
28N66.9Low65.5Low106 Ų10696.7 Ų96.757%0.56747%0.474SS*.THydrogen-bonded Turntrans61.124.6-173.1-51.3-70.5000113.7N25N25-N28 PolarHBondContact O-N 3.43Å
29L63.5Low65.2Low95 Ų9599.5 Ų99.550%0.49749%0.488SS..EExtended strand (participates in β ladder)trans-107.2132.1176.8-64.6174000109.1T27 F31T27-L29 PolarHBondContact O-N 3.15Å; L29-F31 HydrophobicContact CB-CE2 3.89Å; L29-F31 HydrophobicContact CB-CZ 4.36Å; L29-F31 HydrophobicContact CD1-CZ 4.4Å
30M70.4Confident65Low43 Ų4396.4 Ų96.421%0.21249%0.485CS..EExtended strand (participates in β ladder)trans-108.1134.7167.1-80.3-173.8-56.200109.7M9 T11 V22 E24 F32 I50M9-M30 HydrophobicContact CE-CE 2.93Å; M9-M30 HydrophobicContact CE-CG 4.18Å; M9-M30 HydrophobicContact CE-SD 3.26Å; M9-M30 WeakPolarHBondContact CE-SD 3.35Å; T11-M30 HydrophobicContact CG2-CE 4.37Å; T11-M30 HydrophobicContact CG2-SD 4.05Å; V22-M30 HydrophobicContact CG1-CG 4.12Å; V22-M30 HydrophobicContact CG1-SD 4.05Å; E24-M30 HydrophobicContact CG-CG 4.18Å; M30-F32 HydrophobicContact CB-CE1 4.45Å; M30-F32 HydrophobicContact CB-CE2 4.02Å; M30-F32 HydrophobicContact CB-CZ 3.88Å; M30-F32 HydrophobicContact CE-CE2 4.04Å; M30-F32 HydrophobicContact CE-CZ 3.53Å; M30-F32 HydrophobicContact CG-CZ 4.36Å; M30-F32 HydrophobicContact SD-CE1 4.06Å; M30-F32 HydrophobicContact SD-CE2 4.48Å; M30-F32 HydrophobicContact SD-CZ 3.56Å; M30-F32 VanDerWaalsContact SD-CZ 3.56Å; M30-I50 HydrophobicContact CE-CD1 3.61Å; M30-I50 HydrophobicContact CE-CG1 4.05Å
31F69.3Low65Low123 Ų12397.9 Ų97.954%0.53951%0.505SS..EExtended strand (participates in β ladder)trans-112.8135.8168.8-60.5-92.3000108.9Y23 L29Y23-F31 PolarHBondContact N-O 3.34Å; Y23-F31 VanDerWaalsContact N-O 3.16Å; Y23-F31 PolarHBondContact O-N 3.16Å; L29-F31 HydrophobicContact CB-CE2 3.89Å; L29-F31 HydrophobicContact CB-CZ 4.36Å; L29-F31 HydrophobicContact CD1-CZ 4.4Å
32F69.9Low64.8Low57 Ų5798.2 Ų98.225%0.2551%0.51CS..EExtended strand (participates in β ladder)trans-116.5121.3178-58-69.6000109.4T11 F13 V22 M30 I34 I48T11-F32 HydrophobicContact CG2-CE1 3.89Å; T11-F32 HydrophobicContact CG2-CZ 3.79Å; F13-F32 AromaticContact CE1-CD1 3.96Å; F13-F32 HydrophobicContact CE1-CD1 3.96Å; F13-F32 HydrophobicContact CE1-CE1 4.29Å; F13-F32 HydrophobicContact CE1-CG 4.18Å; F13-F32 HydrophobicContact CE2-CD1 4.4Å; F13-F32 HydrophobicContact CE2-CE1 4.35Å; F13-F32 AromaticContact CZ-CD1 3.38Å; F13-F32 HydrophobicContact CZ-CD1 3.38Å; F13-F32 AromaticContact CZ-CE1 3.46Å; F13-F32 HydrophobicContact CZ-CE1 3.46Å; F13-F32 VanDerWaalsContact CZ-CE1 3.46Å; F13-F32 HydrophobicContact CZ-CG 4.06Å; F13-F32 HydrophobicContact CZ-CZ 4.17Å; V22-F32 HydrophobicContact CB-CE1 4.41Å; V22-F32 HydrophobicContact CG1-CD1 4.44Å; V22-F32 HydrophobicContact CG1-CE1 3.93Å; V22-F32 HydrophobicContact CG2-CD1 3.96Å; V22-F32 HydrophobicContact CG2-CE1 3.8Å; M30-F32 HydrophobicContact CB-CE1 4.45Å; M30-F32 HydrophobicContact CB-CE2 4.02Å; M30-F32 HydrophobicContact CB-CZ 3.88Å; M30-F32 HydrophobicContact CE-CE2 4.04Å; M30-F32 HydrophobicContact CE-CZ 3.53Å; M30-F32 HydrophobicContact CG-CZ 4.36Å; M30-F32 HydrophobicContact SD-CE1 4.06Å; M30-F32 HydrophobicContact SD-CE2 4.48Å; M30-F32 HydrophobicContact SD-CZ 3.56Å; M30-F32 VanDerWaalsContact SD-CZ 3.56Å; F32-I34 HydrophobicContact CB-CD1 4.15Å; F32-I34 HydrophobicContact CB-CG1 4.17Å; F32-I48 HydrophobicContact CD2-CD1 4.19Å; F32-I48 HydrophobicContact CE2-CG2 4.28Å; F32-I48 HydrophobicContact CZ-CG2 4.4Å
33Y71.2Confident64.7Low159 Ų159100.6 Ų100.662%0.62452%0.519SS*.EExtended strand (participates in β ladder)trans-99.4116.4165.3-174.3-99.1000108.7Y20 E21 P35Y20-Y33 VanDerWaalsContact CA-O 3.3Å; Y20-Y33 WeakPolarHBondContact CA-O 3.26Å; E21-Y33 PolarHBondContact N-O 3.25Å; E21-Y33 PolarHBondContact O-N 3.22Å; Y33-P35 HydrophobicContact CD1-CG 4.49Å; Y33-P35 HydrophobicContact CE1-CB 4.31Å; Y33-P35 HydrophobicContact CE1-CG 4.11Å
34I69.7Low64.8Low29 Ų2999.9 Ų99.915%0.14952%0.521CS..  trans-128.199.5-176-53.3172.9000107.6F13 L18 F32 C36 I46 I48F13-I34 HydrophobicContact CD1-CD1 3.68Å; F13-I34 HydrophobicContact CE1-CD1 3.64Å; L18-I34 HydrophobicContact CB-CG2 3.99Å; L18-I34 HydrophobicContact CD1-CG2 3.77Å; L18-I34 HydrophobicContact CD2-CG2 4.11Å; L18-I34 HydrophobicContact CG-CG2 4.17Å; F32-I34 HydrophobicContact CB-CD1 4.15Å; F32-I34 HydrophobicContact CB-CG1 4.17Å; I34-C36 PolarHBondContact O-N 2.77Å; I34-C36 VanDerWaalsContact O-N 3.07Å; I34-I46 HydrophobicContact CD1-CG2 3.89Å; I34-I46 HydrophobicContact CG2-CD1 4.05Å; I34-I48 HydrophobicContact CD1-CD1 4.21Å
35P64.4Low65.1Low63 Ų63100.2 Ų100.241%0.40953%0.526SS..  trans-70.1105.117418.5-8.9000108.3L18 Y19 Y33L18-P35 WeakPolarHBondContact CD2-O 3.5Å; Y19-P35 WeakPolarHBondContact O-CD 3.4Å; Y33-P35 HydrophobicContact CD1-CG 4.49Å; Y33-P35 HydrophobicContact CE1-CB 4.31Å; Y33-P35 HydrophobicContact CE1-CG 4.11Å
36C66.9Low65.5Low45 Ų4598.5 Ų98.530%0.30452%0.517SS..  trans-96.7135.917648.10000110.4I34 L38 I43 I46I34-C36 PolarHBondContact O-N 2.77Å; I34-C36 VanDerWaalsContact O-N 3.07Å; C36-L38 PolarHBondContact O-N 3.35Å; C36-I43 HydrophobicContact CB-CG2 4.26Å; C36-I46 HydrophobicContact CB-CD1 4.07Å
37T58.3Low65.8Low114 Ų11495.6 Ų95.670%0.69950%0.498SS*.  trans-76112.7171.1-29.70000107.8I39T37-I39 PolarHBondContact O-N 3.41Å
38L57.3Low66.4Low110 Ų11095.8 Ų95.858%0.57650%0.495SS*.  trans-68.9114.7173.3-73.9165.1000109C36 I43C36-L38 PolarHBondContact O-N 3.35Å; L38-I43 HydrophobicContact CD2-CG1 3.56Å
39I57.8Low66.8Low88 Ų8893 Ų9345%0.45148%0.482SS..BIsolated β-bridgetrans-101.6119.5171-58.3178.9000107.3T37 T41 N42 E44T37-I39 PolarHBondContact O-N 3.41Å; I39-T41 VanDerWaalsContact C-N 3.29Å; I39-T41 PolarHBondContact O-N 2.84Å; I39-N42 PolarHBondContact N-O 2.74Å; I39-N42 PolarHBondContact O-N 2.86Å; I39-E44 HydrophobicContact CD1-CG 4.43Å
40N59.5Low67.4Low140 Ų14091.4 Ų91.475%0.74947%0.474SS*.THydrogen-bonded Turntrans49.347.6-176-67.4-17.7000113N42N40-N42 PolarHBondContact O-N 2.95Å; N40-N42 PolarHBondContact O-ND2 3.05Å
41T67.5Low67.7Low127 Ų12794 Ų9478%0.77949%0.487SS*.THydrogen-bonded Turntrans61.14.8-179610000116.2I39I39-T41 VanDerWaalsContact C-N 3.29Å; I39-T41 PolarHBondContact O-N 2.84Å
42N61.9Low67.7Low111 Ų11190.6 Ų90.659%0.59448%0.477SS*.BIsolated β-bridgetrans-101.3141.3175.5-66.2-49.9000110.1I39 N40I39-N42 PolarHBondContact N-O 2.74Å; I39-N42 PolarHBondContact O-N 2.86Å; N40-N42 PolarHBondContact O-N 2.95Å; N40-N42 PolarHBondContact O-ND2 3.05Å
43I64.8Low67.6Low105 Ų10593.3 Ų93.354%0.53849%0.489SS..PPolyproline II helixtrans-79.5120.8167.1-61.8172.1000105.7C36 L38 I46C36-I43 HydrophobicContact CB-CG2 4.26Å; L38-I43 HydrophobicContact CD2-CG1 3.56Å; I43-I46 HydrophobicContact CG2-CD1 3.92Å; I43-I46 HydrophobicContact CG2-CG1 4.19Å
44E66Low67.4Low116 Ų11694.4 Ų94.454%0.54250%0.5SS..PPolyproline II helixtrans-58.7141.6167.8-76-169.714900109.4I39 I46I39-E44 HydrophobicContact CD1-CG 4.43Å; E44-I46 WeakPolarHBondContact O-CG1 3.2Å; E44-I46 PolarHBondContact O-N 2.95Å
45L68.1Low66.8Low148 Ų148102 Ų10278%0.77554%0.541SS*.PPolyproline II helixtrans-47.9116.7-176.6-174.880.5000110.8
46I71Confident67Low55 Ų55104 Ų10428%0.28255%0.548SS..PPolyproline II helixtrans-98.6116172.6-58.9172.8000107.4L18 I34 C36 I43 E44 I48L18-I46 HydrophobicContact CD1-CG1 4.44Å; I34-I46 HydrophobicContact CD1-CG2 3.89Å; I34-I46 HydrophobicContact CG2-CD1 4.05Å; C36-I46 HydrophobicContact CB-CD1 4.07Å; I43-I46 HydrophobicContact CG2-CD1 3.92Å; I43-I46 HydrophobicContact CG2-CG1 4.19Å; E44-I46 WeakPolarHBondContact O-CG1 3.2Å; E44-I46 PolarHBondContact O-N 2.95Å; I46-I48 HydrophobicContact CG2-CG1 4.2Å
47E74.3Confident67Low102 Ų102107.1 Ų107.148%0.47756%0.561SS.*EExtended strand (participates in β ladder)trans-101.4127.8173.1-160.4179.4133.500110.1F13 I14F13-E47 WeakPolarHBondContact CA-O 3.41Å; I14-E47 HydrophobicContact CB-CB 4.47Å; I14-E47 PolarHBondContact N-O 3.28Å; I14-E47 VanDerWaalsContact N-O 3.15Å; I14-E47 PolarHBondContact O-N 3.04Å
48I75.1Confident67.5Low75 Ų75106.7 Ų106.739%0.38555%0.553SS.*EExtended strand (participates in β ladder)trans-114.3112.1177.2-51.2-180000107.9F13 F32 I34 I46 I50F13-I48 HydrophobicContact CD1-CB 4.45Å; F13-I48 HydrophobicContact CD1-CG1 3.86Å; F13-I48 HydrophobicContact CD1-CG2 4.33Å; F13-I48 HydrophobicContact CE1-CB 4.18Å; F13-I48 HydrophobicContact CE1-CD1 3.94Å; F13-I48 HydrophobicContact CE1-CG1 3.68Å; F13-I48 HydrophobicContact CE1-CG2 3.68Å; F13-I48 HydrophobicContact CZ-CG2 4.13Å; F32-I48 HydrophobicContact CD2-CD1 4.19Å; F32-I48 HydrophobicContact CE2-CG2 4.28Å; F32-I48 HydrophobicContact CZ-CG2 4.4Å; I34-I48 HydrophobicContact CD1-CD1 4.21Å; I46-I48 HydrophobicContact CG2-CG1 4.2Å; I48-I50 HydrophobicContact CG2-CG1 4.46Å
49T77Confident68.1Low48 Ų48106.5 Ų106.529%0.29455%0.552SS.*EExtended strand (participates in β ladder)trans-103.8119.7173.1-42.20000109.8T11 R12 I51T11-T49 WeakPolarHBondContact CA-O 3.48Å; R12-T49 PolarHBondContact N-O 3.05Å; R12-T49 PolarHBondContact O-N 3.04Å; T49-I51 HydrophobicContact CG2-CD1 4.37Å; T49-I51 HydrophobicContact CG2-CG1 3.89Å
50I74.8Confident68.7Low62 Ų62107.7 Ų107.732%0.31856%0.558SS.*EExtended strand (participates in β ladder)trans-98.1113.1171.8-59.5166.4000108Y5 M9 T11 M30 I48Y5-I50 HydrophobicContact CE2-CG2 4.18Å; M9-I50 HydrophobicContact CB-CG2 4.25Å; M9-I50 HydrophobicContact CE-CG2 3.8Å; M9-I50 HydrophobicContact SD-CG2 4.25Å; T11-I50 HydrophobicContact CG2-CG1 4.28Å; M30-I50 HydrophobicContact CE-CD1 3.61Å; M30-I50 HydrophobicContact CE-CG1 4.05Å; I48-I50 HydrophobicContact CG2-CG1 4.46Å
51I76.1Confident69.3Low96 Ų96105.5 Ų105.549%0.49255%0.545SS..EExtended strand (participates in β ladder)trans-107.2109.8178.4-54.7176.1000108.1R10 T49R10-I51 PolarHBondContact N-O 3.18Å; R10-I51 PolarHBondContact O-N 3Å; T49-I51 HydrophobicContact CG2-CD1 4.37Å; T49-I51 HydrophobicContact CG2-CG1 3.89Å
52P69.7Low69.4Low52 Ų52104 Ų10434%0.33853%0.528SS..EExtended strand (participates in β ladder)trans-60.8139.6171.114.8-22.4000111.7Y5 Q54Y5-P52 HydrophobicContact CD1-CB 3.51Å; Y5-P52 HydrophobicContact CD1-CG 4.03Å; Y5-P52 HydrophobicContact CE1-CB 3.83Å; Y5-P52 HydrophobicContact CE1-CG 3.82Å; Y5-P52 HydrophobicContact CG-CB 4.47Å; P52-Q54 PolarHBondContact O-N 3.17Å
53K69Low70Confident115 Ų115103.5 Ų103.550%0.552%0.523SS..PPolyproline II helixtrans-67.4128.6165.1-75.8-178.8178.1173.80108.4H7 G8H7-K53 HydrophobicContact CB-CB 3.97Å; H7-K53 WeakPolarHBondContact CB-O 3.3Å; H7-K53 WeakPolarHBondContact O-CB 3.4Å; H7-K53 WeakPolarHBondContact O-CD 3.5Å; G8-K53 PolarHBondContact O-N 3.07Å
54Q65.9Low70.5Confident181 Ų181103.3 Ų103.385%0.84652%0.522SS*.PPolyproline II helixtrans-93.9141.3169.5-64.2-160.2-1600109.2P52P52-Q54 PolarHBondContact O-N 3.17Å
55N58.6Low70.9Confident190 Ų190102.2 Ų102.2100%1.01652%0.52SS*.  trans-74.50172.4-106.512.3000111.2H7H7-N55 PolarHBondContact CE1-ND2 3.35Å; H7-N55 PolarHBondContact CE1-OD1 3.07Å; H7-N55 PolarHBondContact ND1-OD1 3.47Å; H7-N55 PolarHBondContact NE2-ND2 3.39Å

Retrieved 55 of 55 residues in 39 ms (Link to these results)